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1-Isopropylideneindan-2-one
SpectraBase Compound ID 9xAcU31G2TV
InChI InChI=1S/C12H12O/c1-8(2)12-10-6-4-3-5-9(10)7-11(12)13/h3-6H,7H2,1-2H3
InChIKey JWHDHURQDMSFKY-UHFFFAOYSA-N
Mol Weight 172.23 g/mol
Molecular Formula C12H12O
Exact Mass 172.088815 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 83PD4at0pm6
Name 1-Isopropylideneindan-2-one
Appearance Colorless solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12O
InChI InChI=1S/C12H12O/c1-8(2)12-10-6-4-3-5-9(10)7-11(12)13/h3-6H,7H2,1-2H3
InChIKey JWHDHURQDMSFKY-UHFFFAOYSA-N
Instrument Name FINNIGAN TSQ 700-HP 5890A
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.11.42
Molecular Weight 172.227 g/mol
SMILES C(C)(C)=C1C(Cc2c1cccc2)=O
SPLASH splash10-004i-0900000000-2a1601ce9bcefbb15ff4
Source of Spectrum BJO-11-SM5-13
Wiley ID 1851659